6,7-dinitro-2-(5-nitro-2-oxidanyl-phenyl)benzo[de]isoquinoline-1,3-dione

Systemtic Name: 6,7-dinitro-2-(5-nitro-2-oxidanyl-phenyl)benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(2-hydroxy-5-nitro-phenyl)-6,7-dinitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(2-hydroxy-5-nitrophenyl)-6,7-dinitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(2-hydroxy-5-nitrophenyl)-6,7-dinitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(2-hydroxy-5-nitro-phenyl)-6,7-dinitro-benzo[de]isoquinoline-1,3-quinone Formula: C18H8N4O9 MolecularWeight: 424.27752

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])N2C(=O)C3=C4C(=CC=C(C4=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C2=O)O

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])N2C(=O)C3=C4C(=CC=C(C4=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C2=O)O

InChI

InChI=1S/C18H8N4O9/c23-14-6-1-8(20(26)27)7-13(14)19-17(24)9-2-4-11(21(28)29)16-12(22(30)31)5-3-10(15(9)16)18(19)25/h1-7,23H